ATOM 44
1 C1y C 23.6572 -24.8314
2 C1y C 24.0689 -23.5414
3 C1z C 22.2959 -24.8314
4 O2a O 24.3815 -26.3980
5 O2a O 25.3298 -22.4506
6 O2x O 22.9735 -22.7515
7 C1y C 21.8900 -23.5414
8 C1b C 20.9521 -25.3669
9 O1a O 21.9307 -26.1333
10 C1y C 23.0028 -28.0720
11 C1y C 25.3356 -21.1080
12 C1a C 20.6115 -23.1167
13 O1a O 19.8860 -24.5362
14 C1y C 23.0028 -29.4320
15 O2x O 21.8188 -27.3942
16 C1y C 24.1633 -20.4187
17 C1y C 26.5138 -20.4187
18 C1y C 21.8188 -30.1214
19 N1b N 24.1692 -30.1038
20 C1y C 20.6463 -28.0720
21 C1y C 24.1633 -19.0516
22 N1b N 22.6028 -21.1547
23 C1y C 26.5138 -19.0516
24 O1a O 27.6860 -21.0964
25 C1y C 20.6463 -29.4320
26 O1a O 21.8129 -31.4500
27 C1b C 19.4941 -27.4082
28 C1y C 25.3356 -18.3796
29 O1a O 23.1916 -17.9738
30 C2c C 21.4419 -20.4711
31 O2b O 27.9218 -18.7272
32 O1a O 19.4801 -30.1038
33 N1b N 25.3298 -17.0313
34 N1a N 21.4478 -19.1286
35 N2a N 20.2696 -21.1430
36 P1b P 29.2715 -18.7272
37 C2c C 26.4964 -16.3536
38 O1c O 30.6269 -18.7389
39 O1c O 29.2772 -17.3848
40 O1c O 29.2656 -20.0828
41 N1a N 27.6686 -17.0255
42 N2a N 26.5605 -15.0014
43 C1a C 25.3765 -29.4052
44 O1a O 18.3334 -28.0740
BOND 46
1 1 3 1
2 1 4 1 #Down
3 2 5 1 #Up
4 2 6 1
5 3 7 1
6 3 8 1 #Up
7 3 9 1
8 10 4 1 #Up
9 11 5 1 #Down
10 7 12 1 #Down
11 8 13 1
12 10 14 1
13 10 15 1
14 11 16 1
15 11 17 1
16 14 18 1
17 14 19 1 #Up
18 15 20 1
19 16 21 1
20 16 22 1 #Up
21 17 23 1
22 17 24 1 #Up
23 18 25 1
24 18 26 1 #Down
25 20 27 1 #Down
26 21 28 1
27 21 29 1 #Down
28 22 30 1
29 23 31 1 #Down
30 25 32 1 #Up
31 28 33 1 #Up
32 30 34 1
33 30 35 2
34 31 36 1
35 33 37 1
36 36 38 1
37 36 39 1
38 36 40 2
39 37 41 1
40 37 42 2
41 6 7 1
42 20 25 1
43 23 28 1
44 19 43 1
45 1 2 1
46 27 44 1
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